Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
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Found 7 results

Search term: FROBCXTULYFHEJ (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
16736385

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1
C22H22ClN3O5443.880241431524
77697

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3
C22H22ClN3O5443.8802233300
11677261

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m0/s1
C22H22ClN3O5443.88023500
71048029

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/i12+2
C2114CH22ClN3O5445.87271100
71048076

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/i17+2,18+2
C2014C2H22ClN3O5447.86531100
110406538

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/i4+2,9+2,12+2,16+2,19+2,20+2
C1614C6H22ClN3O5455.83541100
110406539

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/i5+2,6+2,7+2,8+2,17+2,18+2
C1614C6H22ClN3O5455.83541100

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